Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.
Compound
| ID: | 1141 | |
|---|---|---|
| Name: | 1,2,3,4,5-pentabromo-6-chlorocyclohexane | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Cyclohexane. 1.2.3.4.5-pentabromo-6-chloro- | |
| Labels: | ||
| CAS: | 87-84-3 | |
| InChi Code: | InChI=1S/C6H6Br5Cl/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6H/t1-,2-,3+,4+,5-,6- |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| -0.314174539 |
experimental value |
| 1.397 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID4025828 | US EPA CompTox Dashboard |